%chk=000209501.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209501

0 1
Cl 6.586043 -0.947773 0.206693
O -2.251308 -3.866460 1.353561
O -1.138497 0.723920 -0.449921
O -4.759121 3.566304 -0.082550
N 0.914881 -2.442413 0.074861
N 3.304795 -0.931864 -0.563664
N -3.181819 -1.615653 -0.267676
N -5.226515 1.313767 -0.014267
N -5.412184 -1.187227 0.019104
N -2.946113 2.139852 -0.283606
C 1.204886 -1.133280 0.749717
C 2.202528 -3.130679 -0.272572
C 2.025705 -0.239728 -0.200383
C 3.004548 -2.236355 -1.239811
C 0.060224 -3.324542 0.926981
C -1.381793 -2.772722 0.986768
C 4.157468 -0.065679 -1.444355
C -1.905164 -2.332145 -0.393226
C 4.838247 0.973255 -0.587767
C -3.327883 -0.216393 -0.236441
C -4.723811 0.015215 -0.069288
C -4.446155 -2.159010 -0.092189
C -2.346492 0.834495 -0.341059
C 5.949242 0.657116 0.207886
C 4.369989 2.296735 -0.569113
C -4.338705 2.425309 -0.127742
C -6.682176 1.544229 0.152021
C 6.583326 1.611593 1.008150
C 4.995943 3.263048 0.222483
C -2.055025 3.325918 -0.414454
C 6.099600 2.922282 1.012150
H 1.743767 -1.254608 1.713368
H 0.238241 -0.618626 0.956006
H 1.967062 -4.092735 -0.774359
H 2.823376 -3.360112 0.621613
H 1.401786 0.028712 -1.082636
H 2.279932 0.707375 0.323677
H 3.968647 -2.735284 -1.479156
H 2.441995 -2.114096 -2.190817
H 0.447174 -3.464070 1.958411
H 0.025072 -4.339785 0.466498
H -1.484023 -1.962323 1.741061
H 3.586028 0.419364 -2.267505
H 4.927226 -0.699908 -1.944324
H -2.034426 -3.223607 -1.050392
H -1.143681 -1.663666 -0.890049
H -2.165946 -4.080898 2.301157
H -4.643038 -3.225908 -0.043314
H 3.508553 2.572431 -1.176601
H -6.895565 2.629636 0.185990
H -7.036665 1.077806 1.088790
H -7.238154 1.094668 -0.690328
H 7.441625 1.334882 1.619915
H 4.621542 4.285632 0.225803
H -1.018760 3.048447 -0.147989
H -2.394811 4.139206 0.252255
H -2.065644 3.700857 -1.451983
H 6.583222 3.676696 1.630615


%chk=000209501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209501

0 1
Cl 6.736309 -1.218983 0.220452
O -2.286300 -3.568206 1.659222
O -1.283134 0.822304 -0.293153
O -5.149136 3.516381 -0.111878
N 0.957937 -2.329673 0.128154
N 3.379232 -0.928556 -0.614380
N -3.266039 -1.609516 -0.306174
N -5.465132 1.190264 -0.127559
N -5.528233 -1.283846 -0.163704
N -3.248644 2.146540 -0.216176
C 1.337166 -1.054046 0.794610
C 2.170627 -3.066359 -0.311255
C 2.182779 -0.188249 -0.149585
C 3.000480 -2.199385 -1.271716
C 0.043501 -3.165569 0.930347
C -1.386469 -2.580717 1.030440
C 4.290700 -0.100532 -1.441174
C -1.968718 -2.307775 -0.361796
C 5.071288 0.899410 -0.602189
C -3.475343 -0.219307 -0.256798
C -4.871093 -0.061790 -0.178691
C -4.517431 -2.193057 -0.235213
C -2.555523 0.886884 -0.263279
C 6.172403 0.522993 0.203607
C 4.713629 2.272754 -0.592748
C -4.659911 2.351204 -0.150851
C -6.933925 1.317348 -0.053059
C 6.887511 1.440967 0.996142
C 5.410172 3.218088 0.192746
C -2.435072 3.383995 -0.227024
C 6.498096 2.800440 0.991524
H 1.914674 -1.252354 1.732069
H 0.425103 -0.486812 1.044127
H 1.856199 -3.991795 -0.829584
H 2.814798 -3.353313 0.557015
H 1.538525 0.136314 -1.004868
H 2.510647 0.717668 0.391150
H 3.923135 -2.743207 -1.547915
H 2.402033 -2.026390 -2.202729
H 0.424383 -3.340068 1.972674
H -0.038685 -4.159008 0.448377
H -1.386837 -1.639138 1.616346
H 3.738468 0.452177 -2.242679
H 4.997692 -0.787883 -1.941621
H -2.116261 -3.271286 -0.881191
H -1.244086 -1.699163 -0.924451
H -2.039325 -3.682187 2.611185
H -4.652314 -3.270912 -0.223843
H 3.871884 2.594597 -1.218067
H -7.174189 2.389909 -0.024517
H -7.310259 0.815537 0.853856
H -7.398419 0.844165 -0.934187
H 7.734358 1.101620 1.599815
H 5.107557 4.270457 0.180395
H -1.379055 3.080960 -0.273642
H -2.630133 3.973046 0.683950
H -2.700631 4.002580 -1.099800
H 7.048212 3.521677 1.605291


